4-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethyl)piperazine-1-carboxylic acid

Systemtic Name: 4-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethyl)piperazine-1-carboxylic acid Openeye Name: 4-(2-hydroxy-2-oxo-1-phenyl-ethyl)piperazine-1-carboxylic acid CAS Name: 4-(2-hydroxy-2-oxo-1-phenylethyl)-1-piperazinecarboxylic acid IUPAC Name: 4-(2-hydroxy-2-oxo-1-phenylethyl)piperazine-1-carboxylic acid Traditional Name: 4-(2-hydroxy-2-keto-1-phenyl-ethyl)piperazine-1-carboxylic acid Formula: C13H16N2O4 MolecularWeight: 264.27714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C13H16N2O4/c16-12(17)11(10-4-2-1-3-5-10)14-6-8-15(9-7-14)13(18)19/h1-5,11H,6-9H2,(H,16,17)(H,18,19)